3-[4-[8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]propanenitrile

Systemtic Name: 3-[4-[8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]propanenitrile Openeye Name: 3-[4-[8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]phenyl]propanenitrile CAS Name: 3-[4-[8-[2-(3-pyridinyl)ethynyl]-1-imidazo[4,5-c]quinolinyl]phenyl]propanenitrile IUPAC Name: 3-[4-[8-(2-pyridin-3-ylethynyl)imidazo[4,5-c]quinolin-1-yl]phenyl]propanenitrile Traditional Name: 3-[4-[8-[2-(3-pyridyl)ethynyl]imidazo[4,5-c]quinolin-1-yl]phenyl]propionitrile Formula: C26H17N5 MolecularWeight: 399.44668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C#CC2=CC3=C4C(=CN=C3C=C2)N=CN4C5=CC=C(C=C5)CCC#N

Isomeric SMILES

C1=CC(=CN=C1)C#CC2=CC3=C4C(=CN=C3C=C2)N=CN4C5=CC=C(C=C5)CCC#N

InChI

InChI=1S/C26H17N5/c27-13-1-3-19-7-10-22(11-8-19)31-18-30-25-17-29-24-12-9-20(15-23(24)26(25)31)5-6-21-4-2-14-28-16-21/h2,4,7-12,14-18H,1,3H2